tin(4+) ion tetrakis(propan-2-olate)

• ChemBase ID: 303237
• Molecular Formular: C12H28O4Sn
• Molecular Mass: 355.04932
• Monoisotopic Mass: 356.10095338
• SMILES: CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Sn+4]
• Canonical SMILES: [O-]C(C)C.[O-]C(C)C.[O-]C(C)C.[O-]C(C)C.[Sn+4]
• InChI: InChI=1S/4C3H7O.Sn/c4*1-3(2)4;/h4*3H,1-2H3;/q4*-1;+4
• InChIKey: CCTFOFUMSKSGRK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tin(4+) ion tetrakis(propan-2-olate)
• IUPAC Traditional name: tin(4+) ion tetrakis(propan-2-olate)
• Synonyms: Tin(IV) isopropoxide; 异丙醇锡(IV)

Database IDs

• CAS Number: 1184-61-8
• MDL Number: MFCD00145408

CALCULATED PROPERTIES

• Acid pKa: 17.262587
• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 0.2548059
• LogD (pH = 7.4): 0.25480592
• Log P: 0.25480592
• Molar Refractivity: 27.979 cm^3
• Polarizability: 6.5838666 Å^3
• Polar Surface Area: 23.06 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Liquid

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Flammable (F); X
• UN Number: UN1993
• Hazard Class: 3
• Packing Group: II
• Risk Statements: 11-38-41-48/20-63-65-67
• Safety Statements: 16-26-36/37/39-46-62
• TSCA Listed: 否
• GHS Pictograms: GHS02; GHS05; GHS07; GHS08
• GHS Hazard statements: H224-H304-H361-H373-H318-H315-H336
• GHS Precautionary statements: P210-P301+P310-P303+P361+P353-P305+P351+P338-P405-P501A

Product Information

• Purity: 98% (metals basis)
• Concentration: 10% w/v in isopropanol/toluene